Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 20/20 | 0.42 |
| ▸ | SOAT1 | P35610 | 4/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 10/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL902149 | 0.83 | DGAT1 (0.62) | DGAT1SOAT1KCNH2ADORA2ACYP3A4 | |
| SCHEMBL902559 | 0.75 | DGAT1 (0.61) | DGAT1SOAT1KCNH2ADORA2ACYP3A4 | |
| SCHEMBL902020 | 0.73 | DGAT1 (0.59) | DGAT1SOAT1KCNH2ADORA2ACYP3A4 | |
| SCHEMBL902158 | 0.73 | DGAT1 (0.50) | DGAT1SOAT1KCNH2ADORA2A | |
| SCHEMBL902542 | 0.73 | PDE7A (0.37) | DGAT1SOAT1KCNH2CYP3A4CYP2C9 | |
| SCHEMBL901617 | 0.73 | DGAT1 (0.50) | DGAT1SOAT1KCNH2ADORA2A | |
| SCHEMBL902403 | 0.67 | DGAT1 (0.57) | DGAT1SOAT1KCNH2ADORA2A | |
| SCHEMBL902705 | 0.67 | DGAT1 (0.55) | DGAT1SOAT1KCNH2ADORA2A | |
| SCHEMBL902702 | 0.66 | DGAT1 (0.47) | DGAT1SOAT1KCNH2ADORA2A | |
| SCHEMBL10188929 | 0.64 | DGAT1 (0.52) | DGAT1SOAT1KCNH2ADORA2ACYP3A4 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012044567-A2 | IMIDAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2012-04-05 | — | — | WO | disclosed |